N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide

C17H19ClN2O4S — CID 5144321

IUPACN-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O
InChIInChI=1S/C17H19ClN2O4S/c1-17(2,3)16(22)19-14-10-11(8-9-15(14)21)25(23,24)20-13-7-5-4-6-12(13)18/h4-10,20-21H,1-3H3,(H,19,22)
InChIKeyILQFRIYKDMYQOG-UHFFFAOYSA-N
MW382.87 g/mol
LogP3.83
Rot. Bonds4

About N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide

N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide (PubChem CID 5144321) has the molecular formula C17H19ClN2O4S and a molecular weight of 382.87 g/mol. Its IUPAC name is N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide
PubChem CID5144321
Molecular FormulaC17H19ClN2O4S
Molecular Weight382.87 g/mol
Exact Mass382.08
IUPAC NameN-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O
InChIInChI=1S/C17H19ClN2O4S/c1-17(2,3)16(22)19-14-10-11(8-9-15(14)21)25(23,24)20-13-7-5-4-6-12(13)18/h4-10,20-21H,1-3H3,(H,19,22)
InChIKeyILQFRIYKDMYQOG-UHFFFAOYSA-N
XLogP3.83
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.87
LogP ≤ 53.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

potassium 5-[(2-chlorophenyl)sulfamoyl]-2-hydroxybenzoate
CID 23670809
4-chloro-N-[2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 4097318
4-chloro-N-(2-chlorophenyl)-3-methylbenzenesulfonamide
CID 839413
N-[1-[2-[3-[(2-chlorophenyl)sulfamoyl]benzoyl]hydrazinyl]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 24654446
N-[2-chloro-5-[(2-chlorophenyl)sulfamoyl]phenyl]-4-(phenylsulfamoyl)benzamide
CID 4049236
(2S,3aS,7aS)-N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-1-(naphthalene-2-carbonyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxamide
CID 166374029
2-(4-chlorophenoxy)-N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide
CID 100518441
N-(2-chlorophenyl)-3,3-dimethyl-2-oxo-1H-indole-5-sulfonamide
CID 110384518
N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]phenyl]acetamide
CID 113093718
6-chloro-N-[2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 42930090
2,2-dichloro-N-(2-chlorophenyl)-4,4-dimethyl-3-oxopentanamide
CID 3277317
N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 24514729

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide (CID 5144321) is N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O.
What is the InChIKey of N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide?
The InChIKey is ILQFRIYKDMYQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O4S/c1-17(2,3)16(22)19-14-10-11(8-9-15(14)21)25(23,24)20-13-7-5-4-6-12(13)18/h4-10,20-21H,1-3H3,(H,19,22).
What are the key properties of N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide?
N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide has a molecular weight of 382.87 g/mol, XLogP of 3.83, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 5144321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).